| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 20 | Yes |
Popular Name: (3S)-N,N-dimethyl-1-[(3R,4R)-4-(methylamino)chroman-3-yl]pyrrolidin-3-amine (3S)-N,N-dimethyl-1-[(3R,4R)-4-(…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.72 | 5.57 | -91.32 | 3 | 4 | 2 | 34 | 277.412 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | 2.25 | -3.42 | 1 | 4 | 0 | 28 | 275.396 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.72 | 4.64 | -38.51 | 2 | 4 | 1 | 29 | 276.404 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
